5-(4-chlorophenyl)-N-cyclopentyl-4-cyclopropyl-1,2-oxazole-3-carboxamide

C18H19ClN2O2 — CID 67121170

IUPAC5-(4-chlorophenyl)-N-cyclopentyl-4-cyclopropyl-1,2-oxazole-3-carboxamide
SMILESO=C(NC1CCCC1)c1noc(-c2ccc(Cl)cc2)c1C1CC1
InChIInChI=1S/C18H19ClN2O2/c19-13-9-7-12(8-10-13)17-15(11-5-6-11)16(21-23-17)18(22)20-14-3-1-2-4-14/h7-11,14H,1-6H2,(H,20,22)
InChIKeyOEHRLJKYVLTHIK-UHFFFAOYSA-N
MW330.81 g/mol
LogP4.54
Rot. Bonds4

About 5-(4-chlorophenyl)-N-cyclopentyl-4-cyclopropyl-1,2-oxazole-3-carboxamide

5-(4-chlorophenyl)-N-cyclopentyl-4-cyclopropyl-1,2-oxazole-3-carboxamide (PubChem CID 67121170) has the molecular formula C18H19ClN2O2 and a molecular weight of 330.81 g/mol. Its IUPAC name is 5-(4-chlorophenyl)-N-cyclopentyl-4-cyclopropyl-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound Name5-(4-chlorophenyl)-N-cyclopentyl-4-cyclopropyl-1,2-oxazole-3-carboxamide
PubChem CID67121170
Molecular FormulaC18H19ClN2O2
Molecular Weight330.81 g/mol
Exact Mass330.11
IUPAC Name5-(4-chlorophenyl)-N-cyclopentyl-4-cyclopropyl-1,2-oxazole-3-carboxamide
SMILESO=C(NC1CCCC1)c1noc(-c2ccc(Cl)cc2)c1C1CC1
InChIInChI=1S/C18H19ClN2O2/c19-13-9-7-12(8-10-13)17-15(11-5-6-11)16(21-23-17)18(22)20-14-3-1-2-4-14/h7-11,14H,1-6H2,(H,20,22)
InChIKeyOEHRLJKYVLTHIK-UHFFFAOYSA-N
XLogP4.54
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.81
LogP ≤ 54.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(4-chlorophenyl)-N-cyclohexyl-1,2-oxazole-3-carboxamide
CID 17252724
4-chloro-5-(4-fluorophenyl)-N-(oxan-4-yl)-1,2-oxazole-3-carboxamide
CID 67121088
N-cyclopentyl-4-formyl-5-[4-(trifluoromethyl)phenyl]-1,2-oxazole-3-carboxamide
CID 86663337
3-(4-chlorophenyl)-N-cyclopentyl-5-(1-hydroxyethyl)-1,2-oxazole-4-carboxamide
CID 162800200
1-[3-(4-chlorophenyl)-2,1-benzoxazol-5-yl]-N-cyclohexyl-5-methyltriazole-4-carboxamide
CID 17015379
3-(4-chlorophenyl)-N-cyclohexyl-5-(1-hydroxyethyl)-1,2-oxazole-4-carboxamide
CID 163091019
5-(4-chlorophenyl)-N-cycloheptyl-1,3,4-oxadiazole-2-carboxamide
CID 110391563
3-(4-chlorophenyl)-N-cyclohexyl-6,7-dihydro-4H-[1,2]oxazolo[4,3-c]pyridine-5-carboxamide
CID 108780445
(1S,7S)-3-(4-chlorophenyl)-N-cyclohexyl-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene-5-carboxamide
CID 15603150
3-(4-chlorophenyl)-N-cyclohexyl-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene-5-carboxamide
CID 67029401
N-cyclopentyl-5-[3-fluoro-4-(trifluoromethyl)phenyl]-4-(hydroxymethyl)-1,2-oxazole-3-carboxamide
CID 56683582
1-[3-(4-chlorophenyl)-1,2-oxazol-5-yl]-3-cyclohexylurea
CID 112503079

Frequently Asked Questions

What is the IUPAC name of 5-(4-chlorophenyl)-N-cyclopentyl-4-cyclopropyl-1,2-oxazole-3-carboxamide?
The IUPAC name of 5-(4-chlorophenyl)-N-cyclopentyl-4-cyclopropyl-1,2-oxazole-3-carboxamide (CID 67121170) is 5-(4-chlorophenyl)-N-cyclopentyl-4-cyclopropyl-1,2-oxazole-3-carboxamide.
What is the SMILES notation for 5-(4-chlorophenyl)-N-cyclopentyl-4-cyclopropyl-1,2-oxazole-3-carboxamide?
The canonical SMILES for 5-(4-chlorophenyl)-N-cyclopentyl-4-cyclopropyl-1,2-oxazole-3-carboxamide is O=C(NC1CCCC1)c1noc(-c2ccc(Cl)cc2)c1C1CC1.
What is the InChIKey of 5-(4-chlorophenyl)-N-cyclopentyl-4-cyclopropyl-1,2-oxazole-3-carboxamide?
The InChIKey is OEHRLJKYVLTHIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19ClN2O2/c19-13-9-7-12(8-10-13)17-15(11-5-6-11)16(21-23-17)18(22)20-14-3-1-2-4-14/h7-11,14H,1-6H2,(H,20,22).
What are the key properties of 5-(4-chlorophenyl)-N-cyclopentyl-4-cyclopropyl-1,2-oxazole-3-carboxamide?
5-(4-chlorophenyl)-N-cyclopentyl-4-cyclopropyl-1,2-oxazole-3-carboxamide has a molecular weight of 330.81 g/mol, XLogP of 4.54, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-chlorophenyl)-N-cyclopentyl-4-cyclopropyl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 67121170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).